4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide

C15H16N4O2 — CID 103827378

IUPAC4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
SMILESCN1CCC(NC(=O)c2cc(N)c3ccccc3n2)C1=O
InChIInChI=1S/C15H16N4O2/c1-19-7-6-12(15(19)21)18-14(20)13-8-10(16)9-4-2-3-5-11(9)17-13/h2-5,8,12H,6-7H2,1H3,(H2,16,17)(H,18,20)
InChIKeyHIQOUCGKWZGOOC-UHFFFAOYSA-N
MW284.32 g/mol
LogP0.78
Rot. Bonds2

About 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide

4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide (PubChem CID 103827378) has the molecular formula C15H16N4O2 and a molecular weight of 284.32 g/mol. Its IUPAC name is 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide.

Molecular Properties

Compound Name4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
PubChem CID103827378
Molecular FormulaC15H16N4O2
Molecular Weight284.32 g/mol
Exact Mass284.13
IUPAC Name4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide
SMILESCN1CCC(NC(=O)c2cc(N)c3ccccc3n2)C1=O
InChIInChI=1S/C15H16N4O2/c1-19-7-6-12(15(19)21)18-14(20)13-8-10(16)9-4-2-3-5-11(9)17-13/h2-5,8,12H,6-7H2,1H3,(H2,16,17)(H,18,20)
InChIKeyHIQOUCGKWZGOOC-UHFFFAOYSA-N
XLogP0.78
TPSA88.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 50.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(3R)-1-methyl-2-oxopyrrolidin-3-yl]quinoline-2-carboxamide
CID 96506885
4-amino-N-piperidin-4-ylquinoline-2-carboxamide
CID 71141710
4-amino-N-[2-(hydroxymethyl)cyclopentyl]quinoline-2-carboxamide
CID 103856999
4-amino-N-(3-methoxycyclopentyl)quinoline-2-carboxamide
CID 103099401
3-[(2-aminoquinazolin-4-yl)amino]-1-methylpyrrolidin-2-one
CID 106258511
4-amino-N-cyclopentyloxyquinoline-2-carboxamide
CID 83216868
4-aminoquinoline-2-carboxylic acid;hydrochloride
CID 171379335
4-amino-N-carbamoylquinoline-2-carboxamide
CID 18770494
2-amino-4-fluoro-N-(1-methyl-2-oxopyrrolidin-3-yl)benzamide
CID 106249453
4-amino-N-[2-[cyclopropyl(methyl)amino]ethyl]quinoline-2-carboxamide
CID 63375694
4-amino-N-(2-cyclopropyl-2-hydroxyethyl)quinoline-2-carboxamide
CID 115485639
2-(aminomethyl)-N-(1-methyl-2-oxopyrrolidin-3-yl)-1,3-thiazole-4-carboxamide
CID 103810798

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide?
The IUPAC name of 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide (CID 103827378) is 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide.
What is the SMILES notation for 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide?
The canonical SMILES for 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide is CN1CCC(NC(=O)c2cc(N)c3ccccc3n2)C1=O.
What is the InChIKey of 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide?
The InChIKey is HIQOUCGKWZGOOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O2/c1-19-7-6-12(15(19)21)18-14(20)13-8-10(16)9-4-2-3-5-11(9)17-13/h2-5,8,12H,6-7H2,1H3,(H2,16,17)(H,18,20).
What are the key properties of 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide?
4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide has a molecular weight of 284.32 g/mol, XLogP of 0.78, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(1-methyl-2-oxopyrrolidin-3-yl)quinoline-2-carboxamide is sourced from PubChem (CID 103827378), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).